SCHEMBL11048619

SCHEMBL11048619

O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.76
KMT2A Q03164 5/20 0.76
ALDH1A1 P00352 1/20 0.75
NPC1 O15118 5/20 0.73
RAB9A P51151 4/20 0.73
HTT P42858 3/20 0.73
MAPT P10636 2/20 0.73
LMNA P02545 2/20 0.73
NLRP3 Q96P20 2/20 0.73
SMN1; SMN2 Q16637 1/20 0.73
NLRP1 Q9C000 1/20 0.73
EPHX1 P07099 1/20 0.73
ADORA3 P0DMS8 1/20 0.73
CHRM1 P11229 1/20 0.73
SLC6A2 P23975 1/20 0.73
PDE4A P27815 1/20 0.73
EPHX2 P34913 1/20 0.73
ADRA1A P35348 1/20 0.73
OPRM1 P35372 1/20 0.73
PDE3A Q14432 1/20 0.73

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4741253 1.00 MEN1 (0.76) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL5650525 0.91 MAOA (0.67) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL11054644 0.91 CNR1 (0.74) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL4105004 0.91 CNR1 (0.74) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL11055930 0.89 CNR1 (0.70) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL14758356 0.89 MEN1 (0.75) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL3026575 0.89 RAB9A (0.70) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL17119070 0.89 RAB9A (0.70) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL4548119 0.89 CNR1 (0.70) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL14107061 0.89 GRIK1 (0.64) MEN1KMT2AALDH1A1NPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4444863-A UREA COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1984-04-24 US disclosed